› 6vrv

X-ray diffraction
1.74Å resolution

Discovery of SARxxxx92, a pan-PIM kinase inhibitor, efficacious in a KG1 tumor model

Released:
DOI: 10.2210/pdb6vrv/pdb
PDB entry 6vrv coloured by chain, front view.
PDB entry 6vrv coloured by chain, side view.
PDB entry 6vrv coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Discovery of SARxxxx92, a pan-PIM kinase inhibitor, efficacious in a KG1 tumor model.
Barberis C, Erdman P, Czekaj M, Fire L, Pribish J, Tserlin E, Maniar S, Batchelor JD, Liu J, Patel VF, Hebert A, Levit M, Wang A, Sun F, Huang SA
Bioorg Med Chem Lett 30 127625 (2020)
PMID: 33096160

Function and Biology Details

Reaction catalysed: 
ATP + a protein = ADP + a phosphoprotein
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-145753 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Serine/threonine-protein kinase pim-1 Chain: A
Molecule details ›
Chain: A
Length: 274 amino acids
Theoretical weight: 31.6 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P11309 (Residues: 33-306; Coverage: 88%)
Gene name: PIM1
Sequence domains: Protein kinase domain

Ligands and Environments

2 bound ligands:
Ligand WFY 1 x WFY
Ligand GOL 1 x GOL
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 21-ID-F
Spacegroup: P65
Unit cell:
a: 98.804Å b: 98.804Å c: 81.187Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.174 0.172 0.197
Expression system: Escherichia coli

Quick links